SCHEMBL1743418

SCHEMBL1743418

S=C(NCc1ccccn1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.59
GAA P10253 2/20 0.56
RAB9A P51151 4/20 0.55
NPC1 O15118 3/20 0.55
POLB P06746 2/20 0.55
LMNA P02545 1/20 0.55
KEAP1 Q14145 1/20 0.54
MEN1 O00255 2/20 0.53
ALDH1A1 P00352 2/20 0.53
KMT2A Q03164 2/20 0.53
KDM4E B2RXH2 2/20 0.53
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPK14 Q16539 1/20 0.51

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10913233 0.87 SMN1; SMN2 (0.66) SMN1; SMN2RAB9ANPC1POLBMEN1
SCHEMBL12046068 0.87 RAB9A (0.54) SMN1; SMN2RAB9ANPC1POLBLMNA
SCHEMBL10911188 0.87 L3MBTL1 (0.58) SMN1; SMN2RAB9ANPC1POLBLMNA
SCHEMBL11338235 0.84 SMN1; SMN2 (0.70) SMN1; SMN2GAARAB9ANPC1POLB
SCHEMBL12046080 0.84 ALDH1A1 (0.57) SMN1; SMN2RAB9ANPC1POLBLMNA
SCHEMBL10910981 0.84 KMT2A (0.71) SMN1; SMN2RAB9ANPC1MEN1ALDH1A1
SCHEMBL12046038 0.83 SMN1; SMN2 (0.59) SMN1; SMN2GAARAB9ANPC1POLB
SCHEMBL18050209 0.82 SMN1; SMN2 (0.67) SMN1; SMN2GAARAB9ANPC1POLB
SCHEMBL9859901 0.82 SMN1; SMN2 (0.67) SMN1; SMN2RAB9ANPC1LMNAMEN1
SCHEMBL166484 0.79 LMNA (0.82) SMN1; SMN2GAARAB9ANPC1POLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871944-B2 Thiazole derivative and process for producing same GIFU UNIVERSITY (JP) 2014-10-28 US claimed
EP-2389361-B1 TECHNETIUM- AND RHENIUM-BIS(HETEROARYL) COMPLEXES AND METHODS OF USE THEREOF FOR INHIBITING PSMA MOLECULAR INSIGHT PHARM INC (US) 2016-08-24 EP disclosed
EP-2388253-B1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME UNIV GIFU (JP) 2015-02-11 EP disclosed
EP-2388253-B1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME UNIV GIFU (JP) 2015-02-11 EP disclosed
US-8871944-B2 Thiazole derivative and process for producing same GIFU UNIVERSITY (JP) 2014-10-28 US disclosed
US-8871944-B2 Thiazole derivative and process for producing same GIFU UNIVERSITY (JP) 2014-10-28 US disclosed
US-8871944-B2 Thiazole derivative and process for producing same GIFU UNIVERSITY (JP) 2014-10-28 US disclosed
US-20110319616-A1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME GIFU UNIVERSITY (JP) 2011-12-29 US disclosed
US-20110319616-A1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME GIFU UNIVERSITY (JP) 2011-12-29 US disclosed
EP-2388253-A1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME Gifu University (JP) 2011-11-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110319616-A1 THIAZOLE DERIVATIVE AND PROCESS FOR PRODUCING SAME TST, TALDO1, TBCD SMN1; SMN2 4468/4885GAA 526/4885RAB9A 3873/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.